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3-ethyl-4-heptanone

View entire compound with spectra: 3 NMR, 2 FTIR, and 1 MS (GC)

3-ethyl-4-heptanone
SpectraBase Compound ID CvfJnDVhR33
InChI InChI=1S/C9H18O/c1-4-7-9(10)8(5-2)6-3/h8H,4-7H2,1-3H3
InChIKey QMQBUTKELHAKRH-UHFFFAOYSA-N
Mol Weight 142.24 g/mol
Molecular Formula C9H18O
Exact Mass 142.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID V3B0iTFY5L
Name 3-ETHYLHEPTAN-4-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H18O
InChI InChI=1S/C9H18O/c1-4-7-9(10)8(5-2)6-3/h8H,4-7H2,1-3H3
InChIKey QMQBUTKELHAKRH-UHFFFAOYSA-N
Literature Reference Author K.KRUECKERT,B.FLACHSBARTH,S.SCHULZ,U.HENTSCHEL,P.J.WELDON
Literature Reference Citation J.NAT.PROD.,69,863(2006)
Literature Reference DOI 10.1021/np0600797
Molecular Weight 142.241 g/mol
Solvent CDCl3
Source File Reference UWMZ18469